3-[(4-Methoxyphenyl)thio]propanoic acid
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![3-[(4-Methoxyphenyl)thio]propanoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/92ab6c6b663f49f3adb119f03d55f924.png "3-[(4-Methoxyphenyl)thio]propanoic acid")
3-[(4-Methoxyphenyl)thio]propanoic acid
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CAS No:
13739-36-1
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Formula:
C10H12O3S
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Chemical Name:
3-[(4-Methoxyphenyl)thio]propanoic acid
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Synonyms:
Propanoic acid,3-[(4-methoxyphenyl)thio]-;Propionic acid,3-[(p-methoxyphenyl)thio]-;3-[(4-Methoxyphenyl)thio]propanoic acid;3-[(4-Methoxyphenyl)sulfanyl]propionic acid;3-[(4-Methoxyphenyl)sulfanyl]propanoic acid
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CAS No:
Safety Information
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:212.27
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:212.05071541
Monoisotopic Mass:212.05071541
Topological Polar Surface Area:71.8
Heavy Atom Count:14
Complexity:176
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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